(E)-1-(5-chloranyl-1-benzofuran-2-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one hydrochloride

Systemtic Name: (E)-1-(5-chloranyl-1-benzofuran-2-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one hydrochloride Openeye Name: (E)-1-(5-chlorobenzofuran-2-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one hydrochloride CAS Name: (E)-1-(5-chloro-2-benzofuranyl)-3-[4-(methylthio)phenyl]-2-propen-1-one hydrochloride IUPAC Name: (E)-1-(5-chloro-1-benzofuran-2-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one hydrochloride Traditional Name: (E)-1-(5-chlorobenzofuran-2-yl)-3-[4-(methylthio)phenyl]prop-2-en-1-one hydrochloride Formula: C18H14Cl2O2S MolecularWeight: 365.27356

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)C2=CC3=C(O2)C=CC(=C3)Cl.Cl

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/C(=O)C2=CC3=C(O2)C=CC(=C3)Cl.Cl

InChI

InChI=1S/C18H13ClO2S.ClH/c1-22-15-6-2-12(3-7-15)4-8-16(20)18-11-13-10-14(19)5-9-17(13)21-18;/h2-11H,1H3;1H/b8-4+;